4-(3-pyrimidin-2-ylsulfanylpropoxy)aniline

Systemtic Name: 4-(3-pyrimidin-2-ylsulfanylpropoxy)aniline Openeye Name: 4-(3-pyrimidin-2-ylsulfanylpropoxy)aniline CAS Name: 4-[3-(2-pyrimidinylthio)propoxy]aniline IUPAC Name: 4-(3-pyrimidin-2-ylsulfanylpropoxy)aniline Traditional Name: [4-[3-(2-pyrimidylthio)propoxy]phenyl]amine Formula: C13H15N3OS MolecularWeight: 261.3427

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Descriptors Computed from Structure

Canonical SMILES:

C1=CN=C(N=C1)SCCCOC2=CC=C(C=C2)N

Isomeric SMILES

C1=CN=C(N=C1)SCCCOC2=CC=C(C=C2)N

InChI

InChI=1S/C13H15N3OS/c14-11-3-5-12(6-4-11)17-9-2-10-18-13-15-7-1-8-16-13/h1,3-8H,2,9-10,14H2